7-(1,5-dimethylpyrazol-4-yl)-N-(3-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide

C19H18N6O2 — CID 4865272

IUPAC7-(1,5-dimethylpyrazol-4-yl)-N-(3-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
SMILESCOc1cccc(NC(=O)c2cc3nccc(-c4cnn(C)c4C)n3n2)c1
InChIInChI=1S/C19H18N6O2/c1-12-15(11-21-24(12)2)17-7-8-20-18-10-16(23-25(17)18)19(26)22-13-5-4-6-14(9-13)27-3/h4-11H,1-3H3,(H,22,26)
InChIKeyMNXRUWVVUMRRPW-UHFFFAOYSA-N
MW362.39 g/mol
LogP2.70
Rot. Bonds4

About 7-(1,5-dimethylpyrazol-4-yl)-N-(3-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide

7-(1,5-dimethylpyrazol-4-yl)-N-(3-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide (PubChem CID 4865272) has the molecular formula C19H18N6O2 and a molecular weight of 362.39 g/mol. Its IUPAC name is 7-(1,5-dimethylpyrazol-4-yl)-N-(3-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide.

Molecular Properties

Compound Name7-(1,5-dimethylpyrazol-4-yl)-N-(3-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
PubChem CID4865272
Molecular FormulaC19H18N6O2
Molecular Weight362.39 g/mol
Exact Mass362.15
IUPAC Name7-(1,5-dimethylpyrazol-4-yl)-N-(3-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
SMILESCOc1cccc(NC(=O)c2cc3nccc(-c4cnn(C)c4C)n3n2)c1
InChIInChI=1S/C19H18N6O2/c1-12-15(11-21-24(12)2)17-7-8-20-18-10-16(23-25(17)18)19(26)22-13-5-4-6-14(9-13)27-3/h4-11H,1-3H3,(H,22,26)
InChIKeyMNXRUWVVUMRRPW-UHFFFAOYSA-N
XLogP2.70
TPSA86.34 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.39
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 7-(1,5-dimethylpyrazol-4-yl)-N-(3-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide?
The IUPAC name of 7-(1,5-dimethylpyrazol-4-yl)-N-(3-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide (CID 4865272) is 7-(1,5-dimethylpyrazol-4-yl)-N-(3-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide.
What is the SMILES notation for 7-(1,5-dimethylpyrazol-4-yl)-N-(3-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide?
The canonical SMILES for 7-(1,5-dimethylpyrazol-4-yl)-N-(3-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide is COc1cccc(NC(=O)c2cc3nccc(-c4cnn(C)c4C)n3n2)c1.
What is the InChIKey of 7-(1,5-dimethylpyrazol-4-yl)-N-(3-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide?
The InChIKey is MNXRUWVVUMRRPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N6O2/c1-12-15(11-21-24(12)2)17-7-8-20-18-10-16(23-25(17)18)19(26)22-13-5-4-6-14(9-13)27-3/h4-11H,1-3H3,(H,22,26).
What are the key properties of 7-(1,5-dimethylpyrazol-4-yl)-N-(3-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide?
7-(1,5-dimethylpyrazol-4-yl)-N-(3-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide has a molecular weight of 362.39 g/mol, XLogP of 2.70, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(1,5-dimethylpyrazol-4-yl)-N-(3-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide is sourced from PubChem (CID 4865272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).